methyl 2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-(4-chloro-2-methylphenoxy)-1-oxoethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C22H20ClNO4S MolecularWeight: 429.9165

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C22H20ClNO4S/c1-13-4-6-15(7-5-13)17-12-29-21(20(17)22(26)27-3)24-19(25)11-28-18-9-8-16(23)10-14(18)2/h4-10,12H,11H2,1-3H3,(H,24,25)